CID 22568530

1-bromo-9,9'-spirobi[9h-fluorene]

Structural Information

Molecular Formula
C25H15Br
SMILES
C1=CC=C2C(=C1)C3=C(C24C5=CC=CC=C5C6=CC=CC=C46)C(=CC=C3)Br
InChI
InChI=1S/C25H15Br/c26-23-15-7-11-19-18-10-3-6-14-22(18)25(24(19)23)20-12-4-1-8-16(20)17-9-2-5-13-21(17)25/h1-15H
InChIKey
ZTISECWDPWDTAH-UHFFFAOYSA-N
Compound name
1-bromo-9,9'-spirobi[fluorene]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

167
Patents

394.0357 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.04298 198.3
[M+Na]+ 417.02492 212.5
[M-H]- 393.02842 210.9
[M+NH4]+ 412.06952 222.7
[M+K]+ 432.99886 198.2
[M+H-H2O]+ 377.03296 197.3
[M+HCOO]- 439.03390 216.7
[M+CH3COO]- 453.04955 211.5
[M+Na-2H]- 415.01037 202.6
[M]+ 394.03515 217.6
[M]- 394.03625 217.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe